1,3,5-trimethyl-N-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)pyrazol-4-amine

Systemtic Name: 1,3,5-trimethyl-N-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)pyrazol-4-amine Openeye Name: 1,3,5-trimethyl-N-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)pyrazol-4-amine CAS Name: 1,3,5-trimethyl-N-[2-nitro-4-(1-pyrrolidinylsulfonyl)phenyl]-4-pyrazolamine IUPAC Name: 1,3,5-trimethyl-N-(2-nitro-4-pyrrolidin-1-ylsulfonylphenyl)pyrazol-4-amine Traditional Name: (2-nitro-4-pyrrolidinosulfonyl-phenyl)-(1,3,5-trimethylpyrazol-4-yl)amine Formula: C16H21N5O4S MolecularWeight: 379.43404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)NC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1C)C)NC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C16H21N5O4S/c1-11-16(12(2)19(3)18-11)17-14-7-6-13(10-15(14)21(22)23)26(24,25)20-8-4-5-9-20/h6-7,10,17H,4-5,8-9H2,1-3H3